1-(1-adamantyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiourea

Systemtic Name: 1-(1-adamantyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiourea Openeye Name: 1-(1-adamantyl)-3-[(E)-(5-nitro-2-furyl)methyleneamino]thiourea CAS Name: 1-(1-adamantyl)-3-[(E)-(5-nitro-2-furanyl)methylideneamino]thiourea IUPAC Name: 1-(1-adamantyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiourea Traditional Name: 1-(1-adamantyl)-3-[(E)-(5-nitro-2-furyl)methyleneamino]thiourea Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=S)NN=CC4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=S)N/N=C/C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O3S/c21-20(22)14-2-1-13(23-14)9-17-19-15(24)18-16-6-10-3-11(7-16)5-12(4-10)8-16/h1-2,9-12H,3-8H2,(H2,18,19,24)/b17-9+